[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol

C15H18N2O — CID 10014625

IUPAC[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol
SMILESCN1CC=C(c2c[nH]c3ccc(CO)cc23)CC1
InChIInChI=1S/C15H18N2O/c1-17-6-4-12(5-7-17)14-9-16-15-3-2-11(10-18)8-13(14)15/h2-4,8-9,16,18H,5-7,10H2,1H3
InChIKeyBLPACQACEQEYPL-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.38
Rot. Bonds2

About [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol

[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol (PubChem CID 10014625) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol.

Molecular Properties

Compound Name[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol
PubChem CID10014625
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol
SMILESCN1CC=C(c2c[nH]c3ccc(CO)cc23)CC1
InChIInChI=1S/C15H18N2O/c1-17-6-4-12(5-7-17)14-9-16-15-3-2-11(10-18)8-13(14)15/h2-4,8-9,16,18H,5-7,10H2,1H3
InChIKeyBLPACQACEQEYPL-UHFFFAOYSA-N
XLogP2.38
TPSA39.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol?
The IUPAC name of [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol (CID 10014625) is [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol.
What is the SMILES notation for [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol?
The canonical SMILES for [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol is CN1CC=C(c2c[nH]c3ccc(CO)cc23)CC1.
What is the InChIKey of [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol?
The InChIKey is BLPACQACEQEYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-17-6-4-12(5-7-17)14-9-16-15-3-2-11(10-18)8-13(14)15/h2-4,8-9,16,18H,5-7,10H2,1H3.
What are the key properties of [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol?
[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol has a molecular weight of 242.32 g/mol, XLogP of 2.38, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methanol is sourced from PubChem (CID 10014625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).